7-(4-ethoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Chemical Structure Depiction of
7-(4-ethoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
7-(4-ethoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Compound characteristics
| Compound ID: | D037-0209 |
| Compound Name: | 7-(4-ethoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate |
| Molecular Weight: | 436.48 |
| Molecular Formula: | C24 H20 O6 S |
| Smiles: | CCOc1ccc(cc1)c1cc(cc2c1OC(=O)S2)OC(COc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4231 |
| logD: | 5.4231 |
| logSw: | -5.4097 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 56.129 |
| InChI Key: | PUPCODRAEJSNHD-UHFFFAOYSA-N |